N-butyl-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-methylacetamide
Chemical Structure Depiction of
N-butyl-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-methylacetamide
N-butyl-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-methylacetamide
Compound characteristics
Compound ID: | C785-2000 |
Compound Name: | N-butyl-2-(5-ethyl-8-oxothieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-7(8H)-yl)-N-methylacetamide |
Molecular Weight: | 346.45 |
Molecular Formula: | C17 H22 N4 O2 S |
Smiles: | CCCCN(C)C(CN1C(c2cc3c(ccs3)n2C(CC)=N1)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.2125 |
logD: | 2.2125 |
logSw: | -2.6901 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 47.631 |
InChI Key: | QLJZYPHCLVTFOM-UHFFFAOYSA-N |